IBS-ZINC02125467 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.0030 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.6260 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.8690 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4880 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1390 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.5500 4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -2.7510 3.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 -3.3460 4.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 -3.7170 5.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 -3.5490 4.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 -4.1650 5.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 -4.3460 5.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5900 -4.9340 5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7760 -5.5320 7.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0220 -5.9970 7.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0920 -5.8720 6.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9240 -5.2830 5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6730 -4.8070 4.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2250 -4.1860 3.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7780 -3.9800 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8810 -3.9000 3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9690 -3.2940 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 -3.1450 3.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.5950 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -3.7040 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1000 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 1.2170 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -1.9280 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -3.5160 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 -2.4550 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7080 -4.4950 6.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9450 -5.6300 7.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1670 -6.4610 8.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0660 -6.2390 6.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7640 -5.1900 4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3000 -2.9460 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 26 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 M END